(E)-4-(1,3-benzothiazol-2-yl)-5-(3-methylthiophen-2-yl)pent-4-enoate

Systemtic Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(3-methylthiophen-2-yl)pent-4-enoate Openeye Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(3-methyl-2-thienyl)pent-4-enoate CAS Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(3-methyl-2-thiophenyl)-4-pentenoate IUPAC Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(3-methylthiophen-2-yl)pent-4-enoate Traditional Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(3-methyl-2-thienyl)pent-4-enoate Formula: C17H14NO2S2- MolecularWeight: 328.42856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=C(CCC(=O)[O-])C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(SC=C1)/C=C(\CCC(=O)[O-])/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15NO2S2/c1-11-8-9-21-15(11)10-12(6-7-16(19)20)17-18-13-4-2-3-5-14(13)22-17/h2-5,8-10H,6-7H2,1H3,(H,19,20)/p-1/b12-10+